2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol

C12H16O3 — CID 102252763

IUPAC2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol
SMILESC=CC[C@@](C)(O)c1cc(OC)ccc1O
InChIInChI=1S/C12H16O3/c1-4-7-12(2,14)10-8-9(15-3)5-6-11(10)13/h4-6,8,13-14H,1,7H2,2-3H3/t12-/m1/s1
InChIKeyOIHHLRDVLSNNCK-GFCCVEGCSA-N
MW208.26 g/mol
LogP2.18
Rot. Bonds4

About 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol

2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol (PubChem CID 102252763) has the molecular formula C12H16O3 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol.

Molecular Properties

Compound Name2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol
PubChem CID102252763
Molecular FormulaC12H16O3
Molecular Weight208.26 g/mol
Exact Mass208.11
IUPAC Name2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol
SMILESC=CC[C@@](C)(O)c1cc(OC)ccc1O
InChIInChI=1S/C12H16O3/c1-4-7-12(2,14)10-8-9(15-3)5-6-11(10)13/h4-6,8,13-14H,1,7H2,2-3H3/t12-/m1/s1
InChIKeyOIHHLRDVLSNNCK-GFCCVEGCSA-N
XLogP2.18
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-tert-butyl-4-methoxyphenol;ethane
CID 91123159
4-methoxy-2-(2-methylbutan-2-yl)phenol
CID 11557455
2-(2,5-dimethoxyphenyl)hex-5-en-2-ol
CID 104656188
2-tert-butyl-4-(4-methoxyphenyl)phenol
CID 135087141
5-methoxy-2-prop-2-enylphenol
CID 6424515
3-(2-hydroxy-4-methoxyphenyl)-3-methylbutanal
CID 23504356
(2S)-2-[4-methoxy-2-(trifluoromethyl)phenyl]but-3-en-2-ol
CID 125449632
2-(ethenoxymethyl)-4-methoxyphenol
CID 45091276
4-methoxy-1-[(2-methylpropan-2-yl)oxy]-2-prop-2-enylbenzene
CID 129010804
4-(4-methoxyphenyl)-2-prop-2-enylphenol
CID 54757995
2-(ethenylsulfanylmethyl)-4-methoxyphenol
CID 170137534
1-bromo-2-(4-methoxyphenyl)pent-4-en-2-ol
CID 102472331

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol?
The IUPAC name of 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol (CID 102252763) is 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol.
What is the SMILES notation for 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol?
The canonical SMILES for 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol is C=CC[C@@](C)(O)c1cc(OC)ccc1O.
What is the InChIKey of 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol?
The InChIKey is OIHHLRDVLSNNCK-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H16O3/c1-4-7-12(2,14)10-8-9(15-3)5-6-11(10)13/h4-6,8,13-14H,1,7H2,2-3H3/t12-/m1/s1.
What are the key properties of 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol?
2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol has a molecular weight of 208.26 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-hydroxypent-4-en-2-yl]-4-methoxyphenol is sourced from PubChem (CID 102252763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).